ethyl 1-(4-methylquinolin-2-yl)-5-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(4-methylquinolin-2-yl)-5-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]pyrazole-4-carboxylate Openeye Name: ethyl 5-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoylamino]-1-(4-methyl-2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[[[2-[3-(1-methylethenyl)phenyl]propan-2-ylamino]-oxomethyl]amino]-1-(4-methyl-2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylquinolin-2-yl)-5-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylcarbamoylamino]pyrazole-4-carboxylate Traditional Name: 5-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamoylamino]-1-(4-methyl-2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C29H31N5O3 MolecularWeight: 497.58814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C(=C2)C)NC(=O)NC(C)(C)C4=CC=CC(=C4)C(=C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C(=C2)C)NC(=O)NC(C)(C)C4=CC=CC(=C4)C(=C)C

InChI

InChI=1S/C29H31N5O3/c1-7-37-27(35)23-17-30-34(25-15-19(4)22-13-8-9-14-24(22)31-25)26(23)32-28(36)33-29(5,6)21-12-10-11-20(16-21)18(2)3/h8-17H,2,7H2,1,3-6H3,(H2,32,33,36)